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2,6-diamino-4-(4-chlorophenyl)-4H-thiopyran-3,5-dicarbonitrile

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2,6-diamino-4-(4-chlorophenyl)-4H-thiopyran-3,5-dicarbonitrile
SpectraBase Compound ID 9wl9Mnoxqkx
InChI InChI=1S/C13H9ClN4S/c14-8-3-1-7(2-4-8)11-9(5-15)12(17)19-13(18)10(11)6-16/h1-4,11H,17-18H2
InChIKey RKTNHDSJVMYSPC-UHFFFAOYSA-N
Mol Weight 288.76 g/mol
Molecular Formula C13H9ClN4S
Exact Mass 288.023645 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DYKVjYbtBQ
Name 2,6-diamino-4-(4-chlorophenyl)-4H-thiopyran-3,5-dicarbonitrile
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C13H9ClN4S/c14-8-3-1-7(2-4-8)11-9(5-15)12(17)19-13(18)10(11)6-16/h1-4,11H,17-18H2
InChIKey RKTNHDSJVMYSPC-UHFFFAOYSA-N
NMR Offset 15.2038
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_1448
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: AG-205/5059447; Labnumber: TSH-1135; IOH_ID: IOH-001449
Temperature 313 °C